tert-butyl N-[[4-[4-(2-ethoxyphenyl)piperazin-1-yl]carbonylphenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-[4-(2-ethoxyphenyl)piperazin-1-yl]carbonylphenyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]phenyl]methyl]carbamate CAS Name: N-[[4-[[4-(2-ethoxyphenyl)-1-piperazinyl]-oxomethyl]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]phenyl]methyl]carbamate Traditional Name: N-[4-(4-o-phenetylpiperazine-1-carbonyl)benzyl]carbamic acid tert-butyl ester Formula: C25H33N3O4 MolecularWeight: 439.54722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC=C(C=C3)CNC(=O)OC(C)(C)C

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC=C(C=C3)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C25H33N3O4/c1-5-31-22-9-7-6-8-21(22)27-14-16-28(17-15-27)23(29)20-12-10-19(11-13-20)18-26-24(30)32-25(2,3)4/h6-13H,5,14-18H2,1-4H3,(H,26,30)